SCHEMBL26679449

SCHEMBL26679449

CCOC(=O)NOC(=O)C1CCC(C(=O)ONC(=O)OCC)CC1

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.46
MAPT P10636 2/20 0.45
RECQL P46063 1/20 0.41
ALDH1A1 P00352 3/20 0.39
PPM1B O75688 1/20 0.39
PTPN1 P18031 1/20 0.39
PPP1CC P36873 1/20 0.39
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
TSHR P16473 1/20 0.38
RAB9A P51151 1/20 0.37
HSD11B1 P28845 1/20 0.37

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL5497744 0.82 EPHX1 (0.43) GAAALDH1A1RAB9A
SCHEMBL8891623 0.77 MAPT (0.60) MAPTALDH1A1PPM1BPTPN1PPP1CC
SCHEMBL2375356 0.77 MAPT (0.60) MAPTALDH1A1PPM1BPTPN1PPP1CC
SCHEMBL4221 0.77
SCHEMBL237380 0.77 MAPT (0.60) MAPTALDH1A1PPM1BPTPN1PPP1CC
SCHEMBL18445858 0.75 GAA (0.48) GAAALDH1A1KMT2A
SCHEMBL8110938 0.75 NAAA (0.42) GAAMAPTALDH1A1MEN1KMT2A
Hydrochloric Acid SCHEMBL28788727 0.74
SCHEMBL136487 0.74 ALDH1A1 (0.50) GAAMAPTALDH1A1KMT2A
SCHEMBL1297615 0.74 GAA (0.59) GAAMAPTALDH1A1PPM1BPTPN1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023219145-A1 IMPROVEMENT OF VITRIMER BY POLYROTAXANE ADDITION 国立大学法人 東京大学 2023-11-16 WO disclosed